(8S,9S,13S,14S)-17-(2-Chloroethynyl)-3,17-Dimethoxy-13-Methyl-7,8,9,11 ,12,14,15,16-Octahydro-6H-Cyclopenta[a]Phenanthrene
[CAS# 7548-44-9]

Identification

• Name: (8S,9S,13S,14S)-17-(2-Chloroethynyl)-3,17-Dimethoxy-13-Methyl-7,8,9,11 ,12,14,15,16-Octahydro-6H-Cyclopenta[a]Phenanthrene
• Synonyms: 19-Nor-17.Alpha.-Pregna-1,3,5(10)-Trien-20-Yne, 21-Chloro-3,17-Dimethoxy-; 19-Norpregna-1,3,5(10)-Trien-20-Yne, 21-Chloro-3,17-Dimethoxy-, (17.Alpha.)-; Bdh 2700
• Molecular Formula: C₂₂H₂₇ClO₂
• Molecular Weight: 358.91
• CAS Registry Number: 7548-44-9
• SMILES: [C@]34([C@H]([C@H]2[C@@H](C1=C(C=C(OC)C=C1)CC2)CC3)CC[C@]4(C#CCl)OC)C
• InChI: 1S/C22H27ClO2/c1-21-10-8-18-17-7-5-16(24-2)14-15(17)4-6-19(18)20(21)9-11-22(21,25-3)12-13-23/h5,7,14,18-20H,4,6,8-11H2,1-3H3/t18-,19-,20+,21+,22-/m1/s1
• InChIKey: CRTBVSMXTMELEJ-LXHROKJGSA-N